AV18319
225122-33-8 | tert-Butyl (1-((cyanomethyl)carbamoyl)cyclohexyl)carbamate
Manufacturer: A2B Chem
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CatalogNumber
AV18319
ChemicalName
tert-Butyl (1-((cyanomethyl)carbamoyl)cyclohexyl)carbamate
CasNumber
225122-33-8
MolecularFormula
C14H23N3O3
MolecularWeight
281.3507
MdlNumber
MFCD24392169
Smiles
N#CCNC(=O)C1(CCCCC1)NC(=O)OC(C)(C)C
Complexity
411
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
5
Xlogp3
1.7
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CatalogNumber: AV18319
ChemicalName: tert-Butyl (1-((cyanomethyl)carbamoyl)cyclohexyl)carbamate
CasNumber: 225122-33-8
MolecularFormula: C14H23N3O3
MolecularWeight: 281.3507
MdlNumber: MFCD24392169
Smiles: N#CCNC(=O)C1(CCCCC1)NC(=O)OC(C)(C)C
Complexity: 411
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 1.7
CatalogNumber:
AV18319
ChemicalName:
tert-Butyl (1-((cyanomethyl)carbamoyl)cyclohexyl)carbamate
CasNumber:
225122-33-8
MolecularFormula:
C14H23N3O3
MolecularWeight:
281.3507
MdlNumber:
MFCD24392169
Smiles:
N#CCNC(=O)C1(CCCCC1)NC(=O)OC(C)(C)C
Complexity:
411
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
1.7
CatalogNumber: AV18320
ChemicalName: ((2S,5R)-5-(4-Amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate
CasNumber: 143491-58-1
MolecularFormula: C12H16FN3O4S
MolecularWeight: 317.3365
MdlNumber: MFCD30185763
Smiles: CCCC(=O)OC[C@@H]1SC[C@@H](O1)n1cc(F)c(=N)[nH]c1=O
Complexity: 497
Covalently-bondedUnitCount: 1
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 6
HydrogenBondDonorCount: 1
RotatableBondCount: 6
Xlogp3: 0.5
CatalogNumber:
AV18320
ChemicalName:
((2S,5R)-5-(4-Amino-5-fluoro-2-oxopyrimidin-1(2H)-yl)-1,3-oxathiolan-2-yl)methyl butyrate
CasNumber:
143491-58-1
MolecularFormula:
C12H16FN3O4S
MolecularWeight:
317.3365
MdlNumber:
MFCD30185763
Smiles:
CCCC(=O)OC[C@@H]1SC[C@@H](O1)n1cc(F)c(=N)[nH]c1=O
Complexity:
497
Covalently-bondedUnitCount:
1
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
6
HydrogenBondDonorCount:
1
RotatableBondCount:
6
Xlogp3:
0.5
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC(c1ccccc1C1CCNCC1)O.Cl
Complexity: 189
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC(c1ccccc1C1CCNCC1)O.Cl
Complexity:
189
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Brc1cnc2c(c1)[nH]c(=O)[nH]c2=O
Complexity: 258
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 0.4
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Brc1cnc2c(c1)[nH]c(=O)[nH]c2=O
Complexity:
258
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
0.4